ID: 57079
SMILES:C1CC(C(C)=C)C(c2c(O)cc(CCCCO)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -18.413
InChIKey:IYXFKMXRIGKEQN-UHFFFAOYSA-N
ID: 57080
SMILES:c1(C)c(CBr)c(O)c(NC(CCl)COc2ncccc2)c2c1OC(C)(C)C1CC=C(C)CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 535.91
CB1 binding score: Not available
InChIKey:LBMIQTBAUCVEQJ-UHFFFAOYSA-N
ID: 57081
SMILES:c1(O)cc(CCCC)cc2c1C1C=C(C(=O)O)C(OC)CC12O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.369
CB1 binding score: -17.288
InChIKey:IIVFZSYMXUFKSK-UHFFFAOYSA-N
ID: 57082
SMILES:C1(C(C)=C)CCC(C)C2C1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.825
InChIKey:ZOQOWBOVOPMLPU-UHFFFAOYSA-N
ID: 57083
SMILES:c1(CCCC)cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 57084
SMILES:C1(=O)CC2C(CC1C)c1c(O)cc(CCCCCO)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.298
InChIKey:JOTCNUKDSATFQR-UHFFFAOYSA-N
ID: 57085
SMILES:O=C(c1ccc2c(c1)OC(C)(C)C1C2CC(CO)=CC1)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -16.324
InChIKey:HPVTXXIGHHEQLC-UHFFFAOYSA-N
ID: 57086
SMILES:Oc1cc(O)c(Cc2cc(O)c(CC=C(C)C)c(O)c2CC=C(C)CCC=C(C)C)c(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.727
CB1 binding score: -17.527
InChIKey:RFVHVWXHGUPZSS-UHFFFAOYSA-N
ID: 57087
SMILES:OCC1(C)C2C(C)(CC(C)CC2c2c(O)cc(CCCCC)cc2O)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.592
CB1 binding score: -12.769
InChIKey:GPBSBYDMXNKFTJ-UHFFFAOYSA-N
ID: 57088
SMILES:C(=Cc1cc(O)cc2c1OC(C)(C)C1CCC(C)=CC12)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.491
CB1 binding score: -14.898
InChIKey:HUKWJTSGSXSISC-UHFFFAOYSA-N
ID: 57089
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1=C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.622
InChIKey:NEBZNJDFIPBXCS-UHFFFAOYSA-N
ID: 57090
SMILES:C12C(C)(Oc3c(c(O)cc(CCC)c3)C1O)CC(O)C(O)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.428
CB1 binding score: -14.564
InChIKey:LFHLFFZDISEGJV-UHFFFAOYSA-N
ID: 57091
SMILES:C(c1c2c(c(CCOC(=O)C)c(O)c1)OC(C)(C)CC2)CCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -15.36
InChIKey:OZSKRZSRLUGTAK-UHFFFAOYSA-N
ID: 57092
SMILES:c1(O)c2c(c(C(O)=O)c(CCCCC)c1)OC(C)(C)C1C2CC(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -15.955
InChIKey:XPMKPNGAEAMVRF-UHFFFAOYSA-N
ID: 57093
SMILES:c1(OCC)c(C2C(C(C)=C)CCC(C)=C2)c(O)ccc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -14.463
InChIKey:GINWAMMYUYGZCM-UHFFFAOYSA-N
ID: 57094
SMILES:C(CC)CCCc1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.264
InChIKey:JSQZQNWIVUSPJH-UHFFFAOYSA-N
ID: 57095
SMILES:O1C2CC3C(=CC2c2c(O)c(C(O)=O)c(CCCCC)cc2OC(=O)C(C)=C1C)C(O)CC3C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 498.616
CB1 binding score: -14.322
InChIKey:YSYZFPSMDAEZBE-UHFFFAOYSA-N
ID: 57096
SMILES:CC(=O)CCC1C(C)(CCC=C(C)C)Cc2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -16.502
InChIKey:JVORDLGAWSQXQU-UHFFFAOYSA-N
ID: 57097
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCC)cc2O)C(C(=C)C)C2OC(=O)C(=C2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -18.19
InChIKey:WCLGWGPZMMACDY-UHFFFAOYSA-N
ID: 57098
SMILES:c1(O)c(O)c2c(c3c1c(CC=O)cc(C)c3)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.457
CB1 binding score: -16.527
InChIKey:AXIRVHBEZFFKNB-UHFFFAOYSA-N
ID: 57099
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(COC(C)=O)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.929
InChIKey:WHZPLZAQBLRNKT-UHFFFAOYSA-N