BMS-181184

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C39H41NO20
Molecular Weight	843.7375
Optical Activity	UNSPECIFIED
Defined Stereocenters	12 / 12
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC2=C(C(=O)C3=CC4=C(C(O)=C3C2=O)C5=C(O)C(C(=O)N[C@H](CO)C(O)=O)=C(C)C=C5[C@H](O[C@@H]6O[C@H](C)[C@H](O)[C@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O)[C@H]4O)C(O)=C1

InChI

InChIKey=AXPBRQZJFXIYTD-XCXKMOQISA-N

InChI=1S/C39H41NO20/c1-10-4-16-23(30(49)20(10)36(53)40-17(8-41)37(54)55)22-14(7-15-24(31(22)50)27(46)13-5-12(56-3)6-18(42)21(13)26(15)45)28(47)34(16)59-39-33(52)35(25(44)11(2)58-39)60-38-32(51)29(48)19(43)9-57-38/h4-7,11,17,19,25,28-29,32-35,38-39,41-44,47-52H,8-9H2,1-3H3,(H,40,53)(H,54,55)/t11-,17-,19-,25+,28+,29+,32-,33-,34+,35+,38+,39+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C39H41NO20
Molecular Weight	843.7375
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	12 / 12
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:53:28 GMT 2023` Edited by `admin` on `Fri Dec 15 15:53:28 GMT 2023`
Record UNII	3BAE3PZN9P
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BMS-181184

Code

English

D-SERINE, N-(((5S,6S)-5-((6-DEOXY-3-O-.BETA.-D-XYLOPYRANOSYL-.BETA.-D-GALACTOPYRANOSYL)OXY)-5,6,8,13-TETRAHYDRO-1,6,9,14-TETRAHYDROXY-11-METHOXY-3-METHYL-8,13-DIOXOBENZO(A)NAPHTHACEN-2-YL)CARBONYL)-

Systematic Name

English

D-SERINE, N-((5-((6-DEOXY-3-O-.BETA.-D-XYLOPYRANOSYL-.BETA.-D-GALACTOPYRANOSYL)OXY)-5,6,8,13-TETRAHYDRO-1,6,9,14-TETRAHYDROXY-11-METHOXY-3-METHYL-8,13-DIOXOBENZO(A)NAPHTHACEN-2-YL)CARBONYL)-, (5S-TRANS)-

Systematic Name

English

PRADIMICIN X

Brand Name

English

BMY-28960

Code

English

Code System Code Type Description

FDA UNII

3BAE3PZN9P

Created by admin on Fri Dec 15 15:53:28 GMT 2023 , Edited by admin on Fri Dec 15 15:53:28 GMT 2023

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PUBCHEM

6918233

Created by admin on Fri Dec 15 15:53:28 GMT 2023 , Edited by admin on Fri Dec 15 15:53:28 GMT 2023

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CAS

139272-69-8

Created by admin on Fri Dec 15 15:53:28 GMT 2023 , Edited by admin on Fri Dec 15 15:53:28 GMT 2023

PRIMARY