GERMITETRINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C41H63NO14
Molecular Weight	793.9372
Optical Activity	UNSPECIFIED
Defined Stereocenters	19 / 19
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](OC(C)=O)[C@@]4([H])[C@]1(O)[C@@H](OC(=O)[C@H](C)CC)[C@H](O)[C@@]6([H])[C@@]2([H])CN7C[C@@H](C)CC[C@@]7([H])[C@@]6(C)O)OC(=O)[C@@](C)(O)[C@@H](C)OC(C)=O

InChI

InChIKey=KBGNYIWYDYVUFP-XDQUZBPMSA-N

InChI=1S/C41H63NO14/c1-10-20(3)34(46)55-33-31(45)30-24(18-42-17-19(2)11-12-28(42)38(30,9)49)25-16-39-32(40(25,33)50)26(53-23(6)44)15-27-36(39,7)14-13-29(41(27,51)56-39)54-35(47)37(8,48)21(4)52-22(5)43/h19-21,24-33,45,48-51H,10-18H2,1-9H3/t19-,20+,21+,24-,25-,26+,27-,28-,29-,30+,31+,32+,33-,36-,37-,38+,39+,40-,41-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C41H63NO14
Molecular Weight	793.9372
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	19 / 19
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:07:55 GMT 2023` Edited by `admin` on `Sat Dec 16 18:07:55 GMT 2023`
Record UNII	13230DE6EK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

GERMITETRINE

Common Name

English

CEVANE-3,4,7,14,15,16,20-HEPTOL, 4,9-EPOXY-, 7-ACETATE 3-(3-(ACETYLOXY)-2-HYDROXY-2-METHYLBUTANOATE) 15-(2-METHYLBUTANOATE), (3.BETA.(2S,3R),4.ALPHA.,7.ALPHA.,15.ALPHA.(R),16.BETA.)-

Systematic Name

English

CEVANE-3,4,7,14,15,16,20-HEPTOL, 4,9-EPOXY-, 7-ACETATE 3-((2S,3R)-3-(ACETYLOXY)-2-HYDROXY-2-METHYLBUTANOATE) 15-((2R)-2-METHYLBUTANOATE), (3.BETA.,4.ALPHA.,7.ALPHA.,15.ALPHA.,16.BETA.)-

Systematic Name

English

BUTANOIC ACID, 3-(ACETYLOXY)-2-HYDROXY-2-METHYL-, (3S,4S,4AS,6R,6AS,6BS,7S,8R,8AR,9S,9AS,12S,15AS,15BS,16AR,16BS)-6-(ACETYLOXY)DOCOSAHYDRO-4,6B,8,9-TETRAHYDROXY-9,12,16B-TRIMETHYL-7-((2R)-2-METHYL-1-OXOBUTOXY)-2H-4,16A-EPOXYBENZO(7,8)FLUORENO(2,1-B)QUINO

Systematic Name

English

CEVANE-3.BETA.,4.BETA.,7.ALPHA.,14,15.ALPHA.,16.BETA.,20-HEPTOL, 4,9-EPOXY-, 7-ACETATE 3-(ERYTHRO-(-)-2,3-DIHYDROXY-2-METHYLBUTYRATE 3-ACETATE) 15-((-)-2-METHYLBUTYRATE)

Systematic Name

English

Code System Code Type Description

CAS

465-75-8

Created by admin on Sat Dec 16 18:07:55 GMT 2023 , Edited by admin on Sat Dec 16 18:07:55 GMT 2023

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FDA UNII

13230DE6EK

Created by admin on Sat Dec 16 18:07:55 GMT 2023 , Edited by admin on Sat Dec 16 18:07:55 GMT 2023

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PUBCHEM

126480246

Created by admin on Sat Dec 16 18:07:55 GMT 2023 , Edited by admin on Sat Dec 16 18:07:55 GMT 2023

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