GERMINE 3,16-DIACETATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C31H47NO10
Molecular Weight	593.7056
Optical Activity	UNSPECIFIED
Defined Stereocenters	16 / 16
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12C[C@]34O[C@]5(O)[C@H](CC[C@@]3(C)[C@]5([H])C[C@@H](O)[C@@]4([H])[C@]1(O)[C@@H](O)[C@H](OC(C)=O)[C@@]6([H])[C@@]2([H])CN7C[C@@H](C)CC[C@@]7([H])[C@@]6(C)O)OC(C)=O

InChI

InChIKey=LDTMLMHQMYAMSL-YHCVCRLOSA-N

InChI=1S/C31H47NO10/c1-14-6-7-21-28(5,37)23-17(13-32(21)12-14)18-11-29-25(30(18,38)26(36)24(23)41-16(3)34)19(35)10-20-27(29,4)9-8-22(40-15(2)33)31(20,39)42-29/h14,17-26,35-39H,6-13H2,1-5H3/t14-,17-,18-,19+,20-,21-,22-,23+,24+,25+,26-,27-,28+,29+,30-,31-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C31H47NO10
Molecular Weight	593.7056
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	15 / 16
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:35:55 GMT 2023` Edited by `admin` on `Fri Dec 15 15:35:55 GMT 2023`
Record UNII	HS0EQ09MX5
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

GERMINE 3,16-DIACETATE

Common Name

English

CEVANE-3,4,7,14,15,16,20-HEPTOL, 4,9-EPOXY-, 3,16- DIACETATE, (3.BETA.,4.ALPHA.,7.ALPHA.,15.ALPHA.,16.BETA.)-

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID00947244

Created by admin on Fri Dec 15 15:35:55 GMT 2023 , Edited by admin on Fri Dec 15 15:35:55 GMT 2023

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PUBCHEM

76956308

Created by admin on Fri Dec 15 15:35:55 GMT 2023 , Edited by admin on Fri Dec 15 15:35:55 GMT 2023

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CAS

24381-53-1

Created by admin on Fri Dec 15 15:35:55 GMT 2023 , Edited by admin on Fri Dec 15 15:35:55 GMT 2023

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FDA UNII

HS0EQ09MX5

Created by admin on Fri Dec 15 15:35:55 GMT 2023 , Edited by admin on Fri Dec 15 15:35:55 GMT 2023

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