ID: 57730
SMILES:c1(CCCCCCCC)c(O)cc2c3c1OC(C)(C)C1C3C(O)C(C)(O2)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -14.303
InChIKey:MDOVSULDQWOIBZ-UHFFFAOYSA-N
ID: 57731
SMILES:C(CCC)Cc1cc2c(c(OC)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 57732
SMILES:CC(=O)Oc1c2c(cc(C)c1)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -18.19
InChIKey:WXPKBXLOFJJUTN-UHFFFAOYSA-N
ID: 57733
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 57734
SMILES:CCCc1cc(O)c2c(c1)OC(C)(C)c1c2cc(C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.382
CB1 binding score: -16.979
InChIKey:HAZNHGCZSAUBNU-UHFFFAOYSA-N
ID: 57735
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(CCCC(O)(C)C)C=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.319
InChIKey:WCYGYBLVAJEPSX-UHFFFAOYSA-N
ID: 57736
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1=C2C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.753
InChIKey:OAHHZUDLEHBUGH-UHFFFAOYSA-N
ID: 57737
SMILES:c1(C=CCO)c(C(OCC)=O)c(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -15.306
InChIKey:GXVPNIHZCULMMU-UHFFFAOYSA-N
ID: 57738
SMILES:CC(C)C1CCC(C)C12CCC(C)=CC2c1c(O)cc(CCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -19.711
InChIKey:JKUNBHBFPDDSCT-UHFFFAOYSA-N
ID: 57739
SMILES:c12c(O)cc(CC)cc1OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.588
InChIKey:JZEQHRTZXSCBRS-UHFFFAOYSA-N
ID: 57740
SMILES:C1(C)(C)Oc2c(c(O)ccc2OC)C2CC(C)=CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.93
InChIKey:ZQCOWWHTOGJZOR-UHFFFAOYSA-N
ID: 57741
SMILES:c1(CCC)cc(O)c(C2C=C(C(C)CCC=C(C)C)CCC(C)=C2)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -17.671
InChIKey:LDSIFMQKGIEMLA-UHFFFAOYSA-N
ID: 57742
SMILES:CC1(C)C2CCC(C=O)=CC2c2c(cc(C)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -17.214
InChIKey:ASRCITNWYBEUHX-UHFFFAOYSA-N
ID: 57743
SMILES:C(C)(C)(O)C(O)C(O)c1cc(O)c2c(c1C)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -15.552
InChIKey:JQBUCRRZKMXOAT-UHFFFAOYSA-N
ID: 57744
SMILES:O(c1cc(CCCCCC)ccc1C1(C)CCCC(C)(C)O1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.528
CB1 binding score: -15.288
InChIKey:HYMBKYVXLKPBAZ-UHFFFAOYSA-N
ID: 57745
SMILES:Oc1cc(CCCCC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 57746
SMILES:C(C)(=CCc1c(O)cc(CCC)cc1O)CCC=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 356.55
CB1 binding score: -18.934
InChIKey:LDZQKZLPWVBJOB-UHFFFAOYSA-N
ID: 57747
SMILES:CC(=CCCC(C)=CCc1c(O)cc(CCC)cc1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 356.55
CB1 binding score: -18.934
InChIKey:LDZQKZLPWVBJOB-UHFFFAOYSA-N
ID: 57748
SMILES:CC12Oc3c(c(O)cc(CCCCC)c3)C(C)(C1)C(OC)=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.015
InChIKey:VUAFTZSWGZJXSK-UHFFFAOYSA-N
ID: 57749
SMILES:c1(C(CC(O)C2OC2(C)C)(C)C=C2c3c(cc(CCCCC)cc3O)OC2(C)C)c(C2(C)C3C(CC2)C(C)(C)C(CC=C(C)C)O3)c(O)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 717
CB1 binding score: -14.041
InChIKey:XCIMVQIYHDZDCZ-UHFFFAOYSA-N
ID: 57750
SMILES:O1c2c(c(OC)cc(CCCCC)c2)C2C1C(C(C)C)CCC2C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -15.059
InChIKey:MGEBQUCETYWTOJ-UHFFFAOYSA-N