IPROCINODINE I

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C40H65N13O13
Molecular Weight	936.0234
Optical Activity	UNSPECIFIED
Defined Stereocenters	13 / 13
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)NCCCCNCCCNC(=O)\C=C\C1=CC=C(O[C@H]2O[C@H](C)[C@@H](NC(=O)N[C@H]3OC[C@@H](O[C@@H]4OC[C@@H](O)[C@@H]5NC(=O)N([C@@H]45)C(N)=O)[C@H](O)[C@H]3NC(N)=O)[C@H](O)[C@H]2NC(N)=N)C=C1

InChI

InChIKey=HIHZTSOUFPWQPT-PEZSZLOSSA-N

InChI=1S/C40H65N13O13/c1-19(2)46-15-5-4-13-45-14-6-16-47-25(55)12-9-21-7-10-22(11-8-21)65-34-29(48-36(41)42)32(57)26(20(3)64-34)50-39(60)52-33-28(49-37(43)58)31(56)24(18-62-33)66-35-30-27(23(54)17-63-35)51-40(61)53(30)38(44)59/h7-12,19-20,23-24,26-35,45-46,54,56-57H,4-6,13-18H2,1-3H3,(H2,44,59)(H,47,55)(H,51,61)(H4,41,42,48)(H3,43,49,58)(H2,50,52,60)/b12-9+/t20-,23-,24-,26-,27+,28-,29-,30-,31+,32+,33+,34-,35+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C40H65N13O13
Molecular Weight	936.0234
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	13 / 13
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:49:16 GMT 2025` Edited by `admin` on `Mon Mar 31 21:49:16 GMT 2025`
Record UNII	5P2279X3YC
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

IPROCINODINE I

Common Name

English

ANTIBIOTIC BM-123.GAMMA.1, 1-(1-METHYLETHYL)-

Preferred Name

English

CINODINE I, 1-(1-METHYLETHYL)-

Common Name

English

Code System Code Type Description

FDA UNII

5P2279X3YC

Created by admin on Mon Mar 31 21:49:16 GMT 2025 , Edited by admin on Mon Mar 31 21:49:16 GMT 2025

PRIMARY

PUBCHEM

72941577

Created by admin on Mon Mar 31 21:49:16 GMT 2025 , Edited by admin on Mon Mar 31 21:49:16 GMT 2025

PRIMARY

CAS

60871-70-7

Created by admin on Mon Mar 31 21:49:16 GMT 2025 , Edited by admin on Mon Mar 31 21:49:16 GMT 2025

PRIMARY