GEISSOSPERMINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C40H48N4O3
Molecular Weight	632.8341
Optical Activity	UNSPECIFIED
Defined Stereocenters	11 / 11
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC[C@@H]1C[N@@]2CC[C@@]34[C@@H]2C[C@@H]1[C@@H]5CO[C@@H]([C@@H]([C@@H]6C[C@@H]7N(CCC8=C7NC9=C8C=CC=C9)C\C6=C\C)C(=O)OC)N([C@H]35)C%10=CC=CC=C4%10

InChI

InChIKey=ISDWYSGTYITCHG-FDOUXRQQSA-N

InChI=1S/C40H48N4O3/c1-4-23-21-43-17-15-40-30-11-7-9-13-32(30)44-37(40)29(27(23)19-34(40)43)22-47-38(44)35(39(45)46-3)28-18-33-36-26(14-16-42(33)20-24(28)5-2)25-10-6-8-12-31(25)41-36/h5-13,23,27-29,33-35,37-38,41H,4,14-22H2,1-3H3/b24-5-/t23-,27+,28-,29+,33+,34+,35-,37+,38+,40-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C40H48N4O3
Molecular Weight	632.8341
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	10 / 10
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:33:39 GMT 2025` Edited by `admin` on `Mon Mar 31 23:33:39 GMT 2025`
Record UNII	8QA0HO25M6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

GEISSOSPERMINE

Common Name

English

GEISSOSPERMINE [MI]

Preferred Name

English

CORYNAN-17-OIC ACID, 19,20-DIDEHYDRO-16-((10.BETA.,13.BETA.,21.BETA.)-23-DEOXY-21,22-DIHYDRO-11-OXA-12,24-SECOSTRYCHNIDIN-10-YL)-, METHYL ESTER, (16R,19E)-

Systematic Name

English

Code System Code Type Description

MERCK INDEX

m5684