ALTERNATIVE DEFINITION for [LARAZOTIDE ACETATE]

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C32H55N9O10.C2H4O2
Molecular Weight	785.8854
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ALTERNATIVE DEFINITION for [LARAZOTIDE ACETATE]

Structure Search

SMILES

CC(O)=O.CC(C)C[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)CN)C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)NCC(O)=O

InChI

InChIKey=NYGCNONRVCGHAT-UFIKZEAMSA-N

InChI=1S/C32H55N9O10.C2H4O2/c1-16(2)12-20(38-30(49)26(17(3)4)39-24(44)14-35-23(43)13-33)28(47)40-27(18(5)6)31(50)37-19(9-10-22(34)42)32(51)41-11-7-8-21(41)29(48)36-15-25(45)46;1-2(3)4/h16-21,26-27H,7-15,33H2,1-6H3,(H2,34,42)(H,35,43)(H,36,48)(H,37,50)(H,38,49)(H,39,44)(H,40,47)(H,45,46);1H3,(H,3,4)/t19-,20-,21-,26-,27-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C32H55N9O10
Molecular Weight	725.8334
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	C2H4O2
Molecular Weight	60.052
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 03:49:52 GMT 2025` Edited by `admin` on `Wed Apr 02 03:49:52 GMT 2025`
Record UNII	FO8S2IW40N
Record Status	`alternative`
Record Version

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					FO8S2IW40N

LARAZOTIDE ACETATE

Related Record Type Details


					FO8S2IW40N

LARAZOTIDE ACETATE

Primary Definition