Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C67H86N16O14 |
Molecular Weight | 1339.4985 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 9 / 9 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)C[C@H](NC(=O)[C@@H](CC1=CNC2=C1C=CC=C2)NC(=O)[C@H](CC3=CC=C(O)C=C3)NC(=O)[C@H](CO)NC(=O)[C@@H](CC4=CNC5=C4C=CC=C5)NC(=O)[C@@H](CC6=CC=CC=C6)NC(=O)[C@H](N)CCC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N7CCC[C@H]7C(=O)NCC(N)=O
InChI
InChIKey=PXPAXWSJGSSYLV-MJXXGEOPSA-N
InChI=1S/C67H86N16O14/c1-37(2)28-49(59(90)76-48(18-10-26-72-67(70)71)66(97)83-27-11-19-55(83)65(96)75-35-56(69)86)78-62(93)52(31-40-33-73-46-16-8-6-14-43(40)46)80-61(92)51(30-39-20-22-42(85)23-21-39)79-64(95)54(36-84)82-63(94)53(32-41-34-74-47-17-9-7-15-44(41)47)81-60(91)50(29-38-12-4-3-5-13-38)77-58(89)45(68)24-25-57(87)88/h3-9,12-17,20-23,33-34,37,45,48-55,73-74,84-85H,10-11,18-19,24-32,35-36,68H2,1-2H3,(H2,69,86)(H,75,96)(H,76,90)(H,77,89)(H,78,93)(H,79,95)(H,80,92)(H,81,91)(H,82,94)(H,87,88)(H4,70,71,72)/t45-,48+,49+,50-,51+,52-,53-,54+,55+/m1/s1
Molecular Formula | C67H86N16O14 |
Molecular Weight | 1339.4985 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 9 / 9 |
E/Z Centers | 1 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:42:23 GMT 2023
by
admin
on
Fri Dec 15 15:42:23 GMT 2023
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Record UNII |
X4M359TOJ4
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Record Status |
Validated (UNII)
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Record Version |
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-
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134812018
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75744-61-5
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admin on Fri Dec 15 15:42:23 GMT 2023 , Edited by admin on Fri Dec 15 15:42:23 GMT 2023
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