ID: 99646
SMILES:C123C(CCCC1(C)C)(Oc1cc(CCCCC)cc(O)c12)CCC=C3C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -18.014
InChIKey:AYNGLJVSGBWJKM-UHFFFAOYSA-N
ID: 99647
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1c2c(O)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.281
InChIKey:KZTIITBECKQIPO-UHFFFAOYSA-N
ID: 99648
SMILES:C1(C)(C)C2C(C=C(C)CC2)c2c(cccc2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.438
InChIKey:CBEWCUWSPDDHMI-UHFFFAOYSA-N
ID: 99649
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -16.515
InChIKey:BYIOERCQWYRJAJ-UHFFFAOYSA-N
ID: 99650
SMILES:CCCCCc1ccc(O)c2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.367
InChIKey:ARCCJNTVTZPGNU-UHFFFAOYSA-N
ID: 99651
SMILES:C1(c2c(O)cc(CCCC)cc2O)C=C(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 99652
SMILES:C(=CCCC(=CCc1c(O)cc(CCC)cc1O)C)C(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -14.803
InChIKey:IYNPTNRTWSIPEQ-UHFFFAOYSA-N
ID: 99653
SMILES:CC(C)Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1OC(C)(CCC=C(C)C)C2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.668
CB1 binding score: -16.176
InChIKey:LWIHPOZJNFZBBV-UHFFFAOYSA-N
ID: 99654
SMILES:Oc1cc(CCCCC)c(C=O)c(O)c1CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 344.495
CB1 binding score: -19.069
InChIKey:ROXSKQXJGMFFHX-UHFFFAOYSA-N
ID: 99655
SMILES:C1CC2(C)Oc3c(c(O)cc(CCCCC)c3O)C(O)C2C(O)(C)CC1C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.563
CB1 binding score: -15.769
InChIKey:KVWWDYIWUWKKKT-UHFFFAOYSA-N
ID: 99656
SMILES:CC(=CCCC(=CCc1c(O)cc(CCC)cc1O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 99657
SMILES:Oc1c(O)cc2c(c1C(C)C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.611
InChIKey:WILDAMJVPRJZSL-UHFFFAOYSA-N
ID: 99658
SMILES:CC(C)=CCCC1(C)Oc2cc(CCCCC)cc(O)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 99659
SMILES:C1C(C)=CCC2C(C)(C)Oc3c(c(OC)cc4c3C=CC(C)(C)O4)C(OC)C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -14.087
InChIKey:MCINTMFNHDVCGE-UHFFFAOYSA-N
ID: 99660
SMILES:CC1C(=O)C2c3c(O)cc(CCCCC)cc3OC(C2C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.437
InChIKey:JYZYIJGUQGVOEY-UHFFFAOYSA-N
ID: 99661
SMILES:C1(O)C(O)C(C)=CC(c2c(-c3cc(O)ccc3)cc(CCCC)cc2O)C1C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -17.08
InChIKey:SCICPVYEUBMQOS-UHFFFAOYSA-N
ID: 99662
SMILES:c1(O)cc(CCCCC)c(C2C(C(CCC=C(C)C)C)CCC(C=O)=C2)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.174
InChIKey:GSQLATXRKDLXEV-UHFFFAOYSA-N
ID: 99663
SMILES:CC(=CCc1c(O)cc(CCc2ccccc2)cc1O)CCC=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.621
CB1 binding score: -19.13
InChIKey:IWSASXREQYAISF-UHFFFAOYSA-N
ID: 99664
SMILES:C(c1cc(OC)c2c(c1)OC(C)(C)c1c-2cc(C)cc1)CC(O)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -12.878
InChIKey:YETZNCVCXDJZNV-UHFFFAOYSA-N
ID: 99665
SMILES:c12c3c(c(CCCCC)cc1O)OC1(C)OC3CC1C(C)(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.904
InChIKey:SWUPYUWNFNHPJV-UHFFFAOYSA-N
ID: 99666
SMILES:c1(O)cc(CO)c(O)cc1CC=C(C)CC(=O)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -16.502
InChIKey:FCXLGXOELQVHHD-UHFFFAOYSA-N