ID: 26104
SMILES:O=C(C1=CC2c3c(cc(CCCCC)cc3OC(CCCC(C)C)(C)CC2)OC1O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -18.443
InChIKey:RVHBRSVGQOXHNJ-UHFFFAOYSA-N
ID: 26105
SMILES:C(C)(CCc1cc(C(=O)O)c(O)c2c1OC(C)(C)C1C2CC(C)=CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.637
InChIKey:HSZNAJZQYAOFKA-UHFFFAOYSA-N
ID: 26106
SMILES:C1(C)(C)Oc2cc(C(C)(C3CC=C(C)CC3)O)ccc2cc1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.731
InChIKey:DRVANTKBRJDHRZ-UHFFFAOYSA-N
ID: 26107
SMILES:C(c1c(O)c(C2C(C(C)C)CCC(C)=C2)cc(O)c1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.591
InChIKey:DNLILOUREYYANS-UHFFFAOYSA-N
ID: 26108
SMILES:C1(CO)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.967
InChIKey:XTDYIISRNODHHT-UHFFFAOYSA-N
ID: 26109
SMILES:C(OCC(C)(CCCC1(C)c2c(cc(C)c(O)c2)OC(C(C)(C)O)C1)c1ccc(O)c(O)c1)(=O)C1(C)CCC(Br)C(C)(C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 677.673
CB1 binding score: -16.539
InChIKey:JHHPUCHBRPLHGQ-UHFFFAOYSA-N
ID: 26110
SMILES:C1(C)CC2c3c(O)cc(CC)cc3OC(CCC=C(CCC=C(C)C)C)(C)C2CC1OC(=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.678
CB1 binding score: -16.356
InChIKey:RGLQUJRQMJFICV-UHFFFAOYSA-N
ID: 26111
SMILES:C1C(O)C2(c3c(cc(CCCCC)cc3O)OC2(C)C)C=C1C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.929
InChIKey:FVIJLLKJJFFJCA-UHFFFAOYSA-N
ID: 26112
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(C)c(OC)cc3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -19.208
InChIKey:DBJJYKXSZRYDDY-UHFFFAOYSA-N
ID: 26113
SMILES:c1(C(O)C(O)Cc2cc(OC)c(O)c(OC)c2)cc(O)c2c(c1)OC(C)(C)C1CCC(C)(O)C1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.577
CB1 binding score: -14.445
InChIKey:BQKREXBPLCUMII-UHFFFAOYSA-N
ID: 26114
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 26115
SMILES:c1(CCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 26116
SMILES:c1(C)cc2c(cc1)C(C)(C)Oc1c2cc(CCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.383
CB1 binding score: -17.201
InChIKey:ZOWBTXLGCAZWKO-UHFFFAOYSA-N
ID: 26117
SMILES:C(CCCCc1ccc(OC2CC(C)=CCC2(C(C)=C)O)c(O)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -12.908
InChIKey:WJEKNXCIDGXXIA-UHFFFAOYSA-N
ID: 26118
SMILES:c1(CC=C(CCC=C(C)C)C)cc(O)cc(CC(Cl)C)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.876
CB1 binding score: -14.712
InChIKey:JOQSXONHZOKJCU-UHFFFAOYSA-N
ID: 26119
SMILES:O(c1c(C2C(C)=CCCC2C)cc(OC(=O)C)cc1)CCCCCCCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -15.704
InChIKey:LRUUYODGGHHYLZ-UHFFFAOYSA-N
ID: 26120
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1OC(C)(C)c3c1C=C2C(=O)C3=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.483
CB1 binding score: -14.202
InChIKey:VWGPPDRDSYSEDW-UHFFFAOYSA-N
ID: 26121
SMILES:C1(C)(O)C2C(c3c(cc(CCCCC)cc3O)OC2(C)C)C(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -14.387
InChIKey:CXLYYTGBTAUWCB-UHFFFAOYSA-N
ID: 26122
SMILES:C1C=C(C)CC(c2c(O)cc(C)cc2O)C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.334
InChIKey:OCTQIDRSDSFRBW-UHFFFAOYSA-N
ID: 26123
SMILES:c1(O)c(C2(C)CCCC(C)(C)O2)ccc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.447
CB1 binding score: -15.963
InChIKey:MRIMQGDLEMOVQW-UHFFFAOYSA-N
ID: 26124
SMILES:COc1c(O)cc2c3c1OC1(C)CC3C(C(C)(C)Oc3cc(C(C)(C)O)c(C(C)(C)C)cc31)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.645
CB1 binding score: -15.211
InChIKey:VTLMWEMUECEQEI-UHFFFAOYSA-N