ID: 121717
SMILES:O=C(C)Oc1c(C)c(C2C(C(=C)C)CCC(C)=C2)c(O)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -13.419
InChIKey:LLMYMXVQZDEVAH-UHFFFAOYSA-N
ID: 121718
SMILES:O(C(C)=O)C(C)(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -17.957
InChIKey:MMOUECRGOJAVPX-UHFFFAOYSA-N
ID: 121719
SMILES:c1(CC2C(C)=CC(c3cc(O)c(CCNC)cc3)CC(=C)C2)c(O)cc(CCCCC)cc1OC(C)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 519.77
CB1 binding score: -15.595
InChIKey:JRCZQABPZRVIHD-UHFFFAOYSA-N
ID: 121720
SMILES:C(O)C1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 121721
SMILES:c1(OC)c(C2C(C(C)=C)CCC(C)=C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.302
InChIKey:IPGGELGANIXRSX-UHFFFAOYSA-N
ID: 121722
SMILES:c1(C)c2c(ccc1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.748
InChIKey:DUNKDOSBWKYQEH-UHFFFAOYSA-N
ID: 121723
SMILES:CC(=CCCC(CC1c2c(c(O)cc(CCC)c2)OC(C)(C)C1=O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -13.593
InChIKey:SVACNPBRZQJRJE-UHFFFAOYSA-N
ID: 121724
SMILES:C1(O)C(C)=C(CCC(=CCOc2c(CC=C(C)C)cc(CCCCC)cc2O)C)C(C)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.722
CB1 binding score: -15.306
InChIKey:GJKVKVSXPPGVPN-UHFFFAOYSA-N
ID: 121725
SMILES:c1(CCC(C=C)(C)OC)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.969
InChIKey:PZEBCPSZZJBVJB-UHFFFAOYSA-N
ID: 121726
SMILES:C(c1c(C2=NCCC2)c(O)c2c(c1)OC(C)(C)C1C2C1)c1c(CC=C(CCC=C(C)C)C)c(O)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 515.694
CB1 binding score: -17.167
InChIKey:MJGQTWWDPGOMKC-UHFFFAOYSA-N
ID: 121727
SMILES:C(c1cc(O)c(C2C=C(C)CCC2C(O)(C)C)c(O)c1)CCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -15.329
InChIKey:CGSFSEIDFPFDGL-UHFFFAOYSA-N
ID: 121728
SMILES:CC1CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.029
InChIKey:HCVJHHUJBXZYBI-UHFFFAOYSA-N
ID: 121729
SMILES:Oc1cc(CC=C)cc2c1C1CC(=C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -15.966
InChIKey:APRYSSNIVLNQNN-UHFFFAOYSA-N
ID: 121730
SMILES:Oc1cc(O)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.561
InChIKey:RRHAEGQFRQNVHT-UHFFFAOYSA-N
ID: 121731
SMILES:O1c2c(c(O)cc(CCCCC)c2)C=CC1(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 121732
SMILES:C1(OC)(c2c(O)c(CC=C(C)C)c3c(c2)OC(C)(C)C2CCC(C)(O)C3)c(C)c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 536.753
CB1 binding score: -13.303
InChIKey:MQGSRFKRNXTZNU-UHFFFAOYSA-N
ID: 121733
SMILES:C1(=O)c2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.322
CB1 binding score: -19.037
InChIKey:WOUJHLUSTPDGBC-UHFFFAOYSA-N
ID: 121734
SMILES:c1c(C)cc2c(c1)C(C)(C)Oc1c-2cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -17.71
InChIKey:KNMCRTPYWNCWFQ-UHFFFAOYSA-N
ID: 121735
SMILES:c1(O)c(O)c(C(=O)O)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.342
CB1 binding score: -16.078
InChIKey:ZNTQFACVLJBUJH-UHFFFAOYSA-N
ID: 121736
SMILES:CC(=CCCc1cc2c(c(OC)c1)CC1C(C)(O2)CCC1C(C)(C)O)C(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: Not available
InChIKey:MNZPJLUZLWDMEC-UHFFFAOYSA-N
ID: 121737
SMILES:C1(=O)c2c(cc(CCCC)cc2OC)OC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 220.268
CB1 binding score: -15.217
InChIKey:IBENLCFXKZMRHI-UHFFFAOYSA-N