ALTERNATIVE DEFINITION for [SELCOPINTIDE]

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C62H105N21O15
Molecular Weight	1384.6288
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ALTERNATIVE DEFINITION for [SELCOPINTIDE]

Structure Search

SMILES

NCCCC[C@H](N)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC2=CC=C(O)C=C2)C(=O)N[C@@H](CCCCN)C(O)=O

InChI

InChIKey=OSCUVTZLPKFJMX-CUZNLEPHSA-N

InChI=1S/C62H105N21O15/c63-27-5-1-11-40(67)51(88)81-47(33-36-17-21-38(85)22-18-36)57(94)78-42(13-3-7-29-65)53(90)79-45(25-26-50(68)87)56(93)75-41(12-2-6-28-64)52(89)76-43(15-9-31-73-61(69)70)54(91)77-44(16-10-32-74-62(71)72)55(92)83-49(35-84)59(96)82-48(34-37-19-23-39(86)24-20-37)58(95)80-46(60(97)98)14-4-8-30-66/h17-24,40-49,84-86H,1-16,25-35,63-67H2,(H2,68,87)(H,75,93)(H,76,89)(H,77,91)(H,78,94)(H,79,90)(H,80,95)(H,81,88)(H,82,96)(H,83,92)(H,97,98)(H4,69,70,73)(H4,71,72,74)/t40-,41-,42-,43-,44-,45-,46-,47-,48-,49-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C62H105N21O15
Molecular Weight	1384.6288
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	10 / 10
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 10:47:05 GMT 2025` Edited by `admin` on `Wed Apr 02 10:47:05 GMT 2025`
Record UNII	EQE8DA5RNW
Record Status	`alternative`
Record Version

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					EQE8DA5RNW

SELCOPINTIDE

Related Record Type Details


					EQE8DA5RNW

SELCOPINTIDE

Primary Definition