ALSACTIDE ACETATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C99H155N29O21S.C2H4O2
Molecular Weight	2179.589
Optical Activity	UNSPECIFIED
Defined Stereocenters	14 / 14
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(O)=O.CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)CCN)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC2=CNC=N2)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC4=CNC5=C4C=CC=C5)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N6CCC[C@H]6C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)NCCCCN

InChI

InChIKey=CRGDPRQFOKFIRD-MVQNXGECSA-N

InChI=1S/C99H155N29O21S.C2H4O2/c1-59(2)84(97(148)113-56-81(132)115-68(26-10-14-40-101)87(138)119-69(27-11-15-41-102)88(139)118-67(25-9-13-39-100)85(136)109-45-18-17-43-104)127-96(147)79-30-20-47-128(79)98(149)73(28-12-16-42-103)116-82(133)55-112-86(137)76(51-62-53-111-66-24-8-7-23-65(62)66)124-89(140)70(29-19-46-110-99(106)107)120-93(144)75(49-60-21-5-4-6-22-60)123-94(145)77(52-63-54-108-58-114-63)125-90(141)71(35-36-83(134)135)121-91(142)72(38-48-150-3)122-95(146)78(57-129)126-92(143)74(117-80(131)37-44-105)50-61-31-33-64(130)34-32-61;1-2(3)4/h4-8,21-24,31-34,53-54,58-59,67-79,84,111,129-130H,9-20,25-30,35-52,55-57,100-105H2,1-3H3,(H,108,114)(H,109,136)(H,112,137)(H,113,148)(H,115,132)(H,116,133)(H,117,131)(H,118,139)(H,119,138)(H,120,144)(H,121,142)(H,122,146)(H,123,145)(H,124,140)(H,125,141)(H,126,143)(H,127,147)(H,134,135)(H4,106,107,110);1H3,(H,3,4)/t67-,68-,69-,70-,71-,72-,73-,74-,75-,76-,77-,78-,79-,84-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C99H155N29O21S
Molecular Weight	2119.537
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	14 / 14
E/Z Centers	10
Optical Activity	UNSPECIFIED

Molecular Formula	C2H4O2
Molecular Weight	60.052
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:59:07 GMT 2023` Edited by `admin` on `Sat Dec 16 09:59:07 GMT 2023`
Record UNII	KY2I3D99GG
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ALSACTIDE ACETATE

Common Name

English

1-.BETA.-ALANINE-17-(N-(4-AMINOBUTYL)-L-LYSINAMIDE)-.ALPHA.1-17-CORTICOTROPIN, ACETATE (SALT)

Systematic Name

English

.ALPHA.1-17-CORTICOTROPIN, 1-.BETA.-ALANINE-17-(L-2,6-DIAMINO-N-(4-AMINOBUTYL)HEXANAMIDE)-, ACETATE (SALT)

Systematic Name

English

ALSACTIDE ACETATE [MI]

Common Name

English

Code System Code Type Description

PUBCHEM

131801049

Created by admin on Sat Dec 16 09:59:07 GMT 2023 , Edited by admin on Sat Dec 16 09:59:07 GMT 2023

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MERCK INDEX

m1580

Created by admin on Sat Dec 16 09:59:07 GMT 2023 , Edited by admin on Sat Dec 16 09:59:07 GMT 2023

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CAS

33194-27-3

Created by admin on Sat Dec 16 09:59:07 GMT 2023 , Edited by admin on Sat Dec 16 09:59:07 GMT 2023

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FDA UNII

KY2I3D99GG

Created by admin on Sat Dec 16 09:59:07 GMT 2023 , Edited by admin on Sat Dec 16 09:59:07 GMT 2023

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