GERMINE 3-ACETATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H45NO9
Molecular Weight	551.6689
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](O)[C@@]6([H])[C@@]2([H])CN7C[C@@H](C)CC[C@@]7([H])[C@@]6(C)O)OC(C)=O

InChI

InChIKey=RJGRAIZFACFDSU-HADMUKOZSA-N

InChI=1S/C29H45NO9/c1-13-5-6-19-26(4,35)21-15(12-30(19)11-13)16-10-27-23(28(16,36)24(34)22(21)33)17(32)9-18-25(27,3)8-7-20(38-14(2)31)29(18,37)39-27/h13,15-24,32-37H,5-12H2,1-4H3/t13-,15-,16-,17+,18-,19-,20-,21+,22+,23+,24-,25-,26+,27+,28-,29-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C29H45NO9
Molecular Weight	551.6689
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 15:16:40 GMT 2023` Edited by `admin` on `Fri Dec 15 15:16:40 GMT 2023`
Record UNII	QX9T554GAT
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

GERMINE 3-ACETATE

Common Name

English

GERMINE 3-ACETATE [MI]

Common Name

English

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

Common Name

English

GERMINE 3-MONOACETATE

Common Name

English

Code System Code Type Description

FDA UNII

QX9T554GAT

Created by admin on Fri Dec 15 15:16:40 GMT 2023 , Edited by admin on Fri Dec 15 15:16:40 GMT 2023

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CAS

23239-27-2

Created by admin on Fri Dec 15 15:16:40 GMT 2023 , Edited by admin on Fri Dec 15 15:16:40 GMT 2023

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MERCK INDEX

m5716

Created by admin on Fri Dec 15 15:16:40 GMT 2023 , Edited by admin on Fri Dec 15 15:16:40 GMT 2023

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Merck Index

PUBCHEM

76968837

Created by admin on Fri Dec 15 15:16:40 GMT 2023 , Edited by admin on Fri Dec 15 15:16:40 GMT 2023

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