Try beta.chemspider
- Double-bond stereo
- 1 of 7 defined stereocentres
3,6-Diamino-N-[(6E)-3-[(6S)-2-amino-6-hydroxy-3,4,5,6-tetrahydro-4-pyrimidinyl]-6-[(carbamoylamino)methylene]-9,12-bis(hydroxymethyl)-2,5,8,11,14-pentaoxo-1,4,7,10,13-pentaazacyclohexadecan-15-yl]hexa namide
C1[C@@H](N=C(NC1C2C(=O)NCC(C(=O)NC(C(=O)NC(C(=O)N/C(=C/NC(=O)N)/C(=O)N2)CO)CO)NC(=O)CC(CCCN)N)N)O
InChI=1S/C25H43N13O10/c26-3-1-2-10(27)4-16(41)32-12-6-30-23(47)18(11-5-17(42)37-24(28)36-11)38-20(44)13(7-31-25(29)48)33-21(45)14(8-39)35-22(46)15(9-40)34-19(12)43/h7,10-12,14-15,17-18,39-40,42H,1-6,8-9,26-27H2,(H,30,47)(H,32,41)(H,33,45)(H,34,43)(H,35,46)(H,38,44)(H3,28,36,37)(H3,29,31,48)/b13-7+/t10?,11?,12?,14?,15?,17-,18?/m0/s1
GXFAIFRPOKBQRV-HAQWAMOBSA-N
CSID:4451672, http://www.chemspider.com/Chemical-Structure.4451672.html (accessed 16:03, May 21, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
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