ChEBI 27 29 0 0 1 0 0 0 0 0 20 V2000 12.2743 -7.7681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1686 -8.6278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7860 -7.4475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7915 -8.0158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7823 -7.4475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7823 -6.2818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7915 -5.7135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7860 -6.2818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7952 -4.8247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1778 -4.8247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2743 -5.7572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1232 -5.7572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5404 -6.7627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1232 -7.7681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8426 -6.7627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9341 -6.0026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0354 -7.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5404 -4.7664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1795 -4.9121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8375 -9.1669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8518 -8.7007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8006 -8.4238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9073 -3.6860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.9040 -9.3967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7786 -10.0444 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.9058 -8.0983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.0275 -10.0475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11 12 2 0 0 0 0 13 12 1 0 0 0 0 12 18 1 1 0 0 0 15 11 1 0 0 0 0 10 11 1 0 0 0 0 14 13 1 0 0 0 0 1 15 1 0 0 0 0 15 16 1 6 0 0 0 15 17 1 1 0 0 0 1 14 1 0 0 0 0 2 1 1 0 0 0 0 1 21 1 1 0 0 0 3 2 1 0 0 0 0 5 6 1 0 0 0 0 7 6 1 0 0 0 0 4 5 1 0 0 0 0 8 7 1 0 0 0 0 3 4 1 0 0 0 0 4 20 2 0 0 0 0 3 8 1 0 0 0 0 9 8 1 0 0 0 0 8 19 1 1 0 0 0 3 22 1 6 0 0 0 9 10 1 0 0 0 0 10 23 1 1 0 0 0 25 24 2 0 0 0 0 26 24 1 0 0 0 0 27 24 1 0 0 0 0 5 26 1 6 0 0 0 M ZZC 1 1 M ZZC 2 2 M ZZC 3 3 M ZZC 4 4 M ZZC 6 6 M ZZC 7 7 M ZZC 8 8 M ZZC 9 9 M ZZC 10 10 M ZZC 11 11 M ZZC 12 12 M ZZC 13 13 M ZZC 14 14 M ZZC 15 15 M ZZC 16 16 M ZZC 17 17 M ZZC 18 18 M ZZC 19 19 M ZZC 20 20 M END > CHEBI:50436 > 10beta-hydroxytaxa-4(20),11-dien-5alpha-yl acetate > 3 > CHEBI:11308; CHEBI:29683 > 5alpha-Acetoxytaxa-4(20),11(12)-dien-10beta-ol; 10beta-Hydroxytaxa-4(20),11-dien-5alpha-yl acetate; 10-beta-hydroxytaxa-4(20),11-dien-5-alpha-yl acetate > 10beta-hydroxytaxa-4(20),11-dien-5alpha-yl acetate > C22H34O3 > 346.50356 > 346.25079 > 0 > [H][C@]12CCC(C)=C([C@@H](O)C[C@]3(C)CC[C@H](OC(C)=O)C(=C)[C@@]3([H])C1)C2(C)C > InChI=1S/C22H34O3/c1-13-7-8-16-11-17-14(2)19(25-15(3)23)9-10-22(17,6)12-18(24)20(13)21(16,4)5/h16-19,24H,2,7-12H2,1,3-6H3/t16-,17+,18-,19-,22-/m0/s1 > BMPKIAPYMZISRD-PQTWGXLHSA-N > 337515-55-6 > C11898 > LMPR0104390006 $$$$