CONDURANGAMINE B

Details

Stereochemistry	UNKNOWN
Molecular Formula	C27H39NO6
Molecular Weight	473.6017
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 11
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]1(CC[C@]2(O)[C@]3([H])CC[C@@]4([H])C[C@@H](O)CC[C@]4(C)[C@@]3([H])[C@H](O)[C@@H](O)[C@]12C)C(C)OC(=O)C5=CC=CN=C5

InChI

InChIKey=YXVMXCMMJVQPPS-HIGGUUCMSA-N

InChI=1S/C27H39NO6/c1-15(34-24(32)16-5-4-12-28-14-16)19-9-11-27(33)20-7-6-17-13-18(29)8-10-25(17,2)21(20)22(30)23(31)26(19,27)3/h4-5,12,14-15,17-23,29-31,33H,6-11,13H2,1-3H3/t15?,17-,18-,19+,20+,21+,22-,23+,25-,26-,27-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C27H39NO6
Molecular Weight	473.6017
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	9 / 11
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:14:11 GMT 2023` Edited by `admin` on `Sat Dec 16 10:14:11 GMT 2023`
Record UNII	0P6X30QT8M
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CONDURANGAMINE B

Common Name

English

PREGNANE-3,11,12,14,20-PENTOL, 20-(3-PYRIDINECARBOXYLATE), (3.BETA.,5.ALPHA.,11.ALPHA.,12.BETA.,14.BETA.)-

Systematic Name

English

Code System Code Type Description

FDA UNII

0P6X30QT8M

Created by admin on Sat Dec 16 10:14:11 GMT 2023 , Edited by admin on Sat Dec 16 10:14:11 GMT 2023

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CAS

55785-27-8

Created by admin on Sat Dec 16 10:14:11 GMT 2023 , Edited by admin on Sat Dec 16 10:14:11 GMT 2023

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PUBCHEM

101277334

Created by admin on Sat Dec 16 10:14:11 GMT 2023 , Edited by admin on Sat Dec 16 10:14:11 GMT 2023

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