ID: 113632
SMILES:C(CC(C)=CCc1c(O)ccc2c1-c1c(O)cc(CCCCC)cc1OC2(C)C)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.674
CB1 binding score: -15.929
InChIKey:SKEGNIAEDFCVQJ-UHFFFAOYSA-N
ID: 113633
SMILES:C(=CCCC1(C)Oc2cc(O)cc(C)c2CC1CC=C(C)C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -15.367
InChIKey:WYPZGPIPMSKUSK-UHFFFAOYSA-N
ID: 113634
SMILES:C1CC(C)=CC(c2c(O)cc(C)cc2O)C1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.979
InChIKey:GKVOVXWEBSQJPA-UHFFFAOYSA-N
ID: 113635
SMILES:C1C2(C(C)(O)C)OC(C)(C1O)C(CC1(C)Oc3c(cc(O)cc3CCCCC)C1)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -15.264
InChIKey:DOKJLZNMYXTTPW-UHFFFAOYSA-N
ID: 113636
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)c1ccc(C)cc1-2)CNCCCN(CC)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.629
CB1 binding score: -16.705
InChIKey:IEUAAKNGAODVMD-UHFFFAOYSA-N
ID: 113637
SMILES:C1C(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 113638
SMILES:C(Cc1c(C(=O)O)c2c(c(O)c1)C=CC(CCC=C(C)C)(C)O2)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.934
InChIKey:LVVBWLIVGSVZPM-UHFFFAOYSA-N
ID: 113639
SMILES:C(CC)Cc1cc(O)cc(CCC2C(C)(CCC(C(C)CCCC(C)C)=O)CCCC23CC(=O)OC3)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 512.775
CB1 binding score: -16.433
InChIKey:UDWJEOHLHVBUBG-UHFFFAOYSA-N
ID: 113640
SMILES:C12(C)OC(C(C)C)(CC1)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.565
InChIKey:ZIDYDJMTJQRULR-UHFFFAOYSA-N
ID: 113641
SMILES:C1(O)C(C)(C)C2Cc3c(O)cc(CCCCC)cc3OC2(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 332.484
CB1 binding score: -17.417
InChIKey:FZMURLFEULIFNG-UHFFFAOYSA-N
ID: 113642
SMILES:C(C1=C2CC3(c4c(cc(CCCCC)cc4O)CC2)C(C=CC1)C=C3)CCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.611
CB1 binding score: -16.337
InChIKey:DQIUJIFCLNIXIL-UHFFFAOYSA-N
ID: 113643
SMILES:Brc1c2c(ccc1C)CC1=CCC(C(C)(C)Oc3cc(CCCCC)cc(O)c3-c3c(O)c(C(O)=O)c(CCCCC)cc3OC)C1(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 733.784
CB1 binding score: -12.934
InChIKey:GFGPSHSMBPPICU-UHFFFAOYSA-N
ID: 113644
SMILES:C12C(C(C)CC=C1C(C)C)Cc1c(CC=C(C)C)c(O)c(OC)c(C(C)(C)C)c1O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -16.32
InChIKey:PQGSQTYREGZXFQ-UHFFFAOYSA-N
ID: 113645
SMILES:Oc1c(C2C=C(C)CCC2C(C)=C)cc(O)c(CC=C(CCC=C(C)C)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -16.476
InChIKey:SVTKUSUUTGMJAO-UHFFFAOYSA-N
ID: 113646
SMILES:C(=C(CCC=C(C)C)C)C(CC(c1c(O)cc(CCCCC)cc1)=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -11.67
InChIKey:ZKFOEFUWOVORLS-UHFFFAOYSA-N
ID: 113647
SMILES:c1(C=CC(C)=O)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -16.52
InChIKey:JGNARUBYBBOFIW-UHFFFAOYSA-N
ID: 113648
SMILES:CSc1c2c(c(OC)cc1OC)C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.48
CB1 binding score: -14.351
InChIKey:BPEFUYLJYOGFOO-UHFFFAOYSA-N
ID: 113649
SMILES:c12c(O)cc(CCCCC=C)cc1OC1(C)CCCC(C)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 328.496
CB1 binding score: -15.295
InChIKey:KLUSCYDWCZQBCJ-UHFFFAOYSA-N
ID: 113650
SMILES:C(c1c(O)c2c(cc1)OC(C)(C)C1C2CC(C)=CC1)CCC(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -16.346
InChIKey:VPAISFIIGFVCLR-UHFFFAOYSA-N
ID: 113651
SMILES:C1(C)CCC2C(C)(C)Oc3c4c(c(C)cc3OC12)C=CC(C)C4
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -14.337
InChIKey:VWRCVEYKDKBZFD-UHFFFAOYSA-N
ID: 113652
SMILES:C(CCc1cc(O)c2c(c1)OC1(C)C2C2C(C(C)C=C3C=C(C)C(=O)O3)CCC2(CO)O1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.59
CB1 binding score: -14.533
InChIKey:UBJNHWPKRJGVMZ-UHFFFAOYSA-N