ID: 54622
SMILES:C1C(C)=CCC2C(C)(C)Oc3cc(C)cc(OC)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.335
InChIKey:VMBUQSKAAZBJSG-UHFFFAOYSA-N
ID: 54623
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2CC1CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.651
InChIKey:CKMSAAFAEFGNEW-UHFFFAOYSA-N
ID: 54624
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 54625
SMILES:C12(C)CCCC(C)(C)C1C(O)c1c(cc(CCCCC)c(O)c1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.556
InChIKey:HEYWUWCTFNCMBQ-UHFFFAOYSA-N
ID: 54626
SMILES:O(CC(O)CO)c1c(CCCCC)cc2c(c1O)C1C(CCC(=C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -14.881
InChIKey:AQNMHNBMVWMDGJ-UHFFFAOYSA-N
ID: 54627
SMILES:O(C)c1c2c(cc(O)c1CCCCC)OC(C)(CCC=C(CCC=C(C)C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -15.396
InChIKey:YRDXLHFNWWEMLP-UHFFFAOYSA-N
ID: 54628
SMILES:C(C)CCCC(C)CCCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.631
CB1 binding score: -17.158
InChIKey:DHYYADJASPZXAQ-UHFFFAOYSA-N
ID: 54629
SMILES:c1c(CCCC(=C)C2CCC(C)(CCO)O2)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -15.041
InChIKey:GBLRMHVINJTNDX-UHFFFAOYSA-N
ID: 54630
SMILES:O=C1OC(C2C3C(C)(Oc4cc(CCCCC)cc(O)c43)CC2)(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.853
InChIKey:NVZXOUOXZYLZSR-UHFFFAOYSA-N
ID: 54631
SMILES:O1c2cc(CCCCC)cc(O)c2C2C1C(C)(C)Oc1c(cc(O)c(C)c1)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.483
CB1 binding score: -16.357
InChIKey:UWRICHUVKIQDSO-UHFFFAOYSA-N
ID: 54632
SMILES:C(C)CCCCc1cc(O)c(C2C=C(C)CCC2C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -18.488
InChIKey:DRBOYSNODSSITK-UHFFFAOYSA-N
ID: 54633
SMILES:c1c(O)ccc(CCc2cc(O)c3c(c2)OC(C)(C)C2CCC(C)=CC32)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.485
CB1 binding score: -16.83
InChIKey:PBEGVXRRRZSVOL-UHFFFAOYSA-N
ID: 54634
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1C(C(O)(C)CCCC(C)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.646
CB1 binding score: -15.354
InChIKey:BPMMHYPABCZPBR-UHFFFAOYSA-N
ID: 54635
SMILES:CC1(C)C2CCC(C)=CC2c2c(cccc2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.438
InChIKey:CBEWCUWSPDDHMI-UHFFFAOYSA-N
ID: 54636
SMILES:C(O)(CO)c1cc2c(cc1O)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.385
CB1 binding score: -15.929
InChIKey:UMVQRXZKOMHMDE-UHFFFAOYSA-N
ID: 54637
SMILES:C1(O)C(C)=C2C(CC1)C(C)(C)Oc1c(c(O)cc(CCC(=O)C)c1)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.67
InChIKey:XRECNFXMVFWDBI-UHFFFAOYSA-N
ID: 54638
SMILES:O=C1c2cc(CCCCCC)cc(O)c2OC2(C)C(C1)C1(C)COC(C)(C)C1CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -16.144
InChIKey:FZOUMEDAFZLNOJ-UHFFFAOYSA-N
ID: 54639
SMILES:C(C=C(C)C)(=O)C12CC1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.265
InChIKey:CEZNZLQCYPVCIC-UHFFFAOYSA-N
ID: 54640
SMILES:CC(C1Oc2cc(CCCCC)cc(O)c2C1O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -15.98
InChIKey:RFXOEVKKGFIVII-UHFFFAOYSA-N
ID: 54641
SMILES:C1=CC(C)(C)Oc2cc(CCC)cc(O)c21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 218.296
CB1 binding score: -17.978
InChIKey:CHBXMMKWGIOKEK-UHFFFAOYSA-N
ID: 54642
SMILES:c1c(C=CC(C)C=C(C(=O)CC(C)C)O)c(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: -14.571
InChIKey:DTJMINLEEXSWJU-UHFFFAOYSA-N