ID: 116950
SMILES:C1C(C)(C)CC(c2ccc(CCCCC)cc2O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.421
CB1 binding score: -16.724
InChIKey:KRQRBBDGVZQXNT-UHFFFAOYSA-N
ID: 116951
SMILES:OC1C(C)(C)Oc2cc(CCCCC)cc(O)c2C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.348
CB1 binding score: -18.149
InChIKey:PWNRYJVNGXSCQW-UHFFFAOYSA-N
ID: 116952
SMILES:C(=O)(C)CCCc1cc2c(c(O)c1)C1(O)C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.929
InChIKey:VQRXOFVNHRXBCS-UHFFFAOYSA-N
ID: 116953
SMILES:C12CCC=C3c4c(c(O)ccc4OC)C(C)(O1)OC(CCCCCCCCC)(C)C2C3=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -14.219
InChIKey:NPSXILSSAHFQIF-UHFFFAOYSA-N
ID: 116954
SMILES:CC1(C)C2CC(O)C(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 116955
SMILES:CC1CCC(C(=C)C)C1c1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.101
InChIKey:XTQYAFIDHQCEBW-UHFFFAOYSA-N
ID: 116956
SMILES:C1CC(C)=CC2C1C(C)(C)Oc1cc(CCCCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.354
InChIKey:OJTMRZHYTZMJKX-UHFFFAOYSA-N
ID: 116957
SMILES:OC(C)(C)C1C(c2c(O)cc(CCC)cc2O)C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -19.168
InChIKey:BMEOABJGGIYLGA-UHFFFAOYSA-N
ID: 116958
SMILES:CC(C1C(c2c(O)ccc(CCCCC)c2)CC1(C)C)C(=CC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.54
CB1 binding score: -16.165
InChIKey:HOONMYKWFDJPHU-UHFFFAOYSA-N
ID: 116959
SMILES:C(C)(=CCCC(C)=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 428.613
CB1 binding score: -18.353
InChIKey:QNRJPRFPLQBROG-UHFFFAOYSA-N
ID: 116960
SMILES:C1CC(C)=CC(c2c(O)cc(C=O)c(O)c2CC(C=C)(C)C)C1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -14.188
InChIKey:SOURIGSGTZKFEM-UHFFFAOYSA-N
ID: 116961
SMILES:C(C=C(C)C(C)=O)CCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -15.288
InChIKey:QIVPFMSUXKFXFV-UHFFFAOYSA-N
ID: 116962
SMILES:C(C)c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.786
InChIKey:YURJBXYTSFIOOT-UHFFFAOYSA-N
ID: 116963
SMILES:C(O)(=O)c1c(CCCCC)cc2c(c1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 116964
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.189
InChIKey:AIOSXAOKGBOYPS-UHFFFAOYSA-N
ID: 116965
SMILES:CC1=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 116966
SMILES:CC(C1CC=C(C)Oc2cc(CCCCC)cc(O)c21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.371
InChIKey:CPJJHHICBJUDHO-UHFFFAOYSA-N
ID: 116967
SMILES:CC(OC1C23C(=C(C)C)CC2C(COC(=O)c2ccc(O)c(OC)c2)(CC1)C1C(c2c(O)cc(CCCCC)cc2O1)O3)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 606.712
CB1 binding score: -14.676
InChIKey:RMGOVIAUJUCHSP-UHFFFAOYSA-N
ID: 116968
SMILES:C1C(C)(C)Oc2c1cc(CCCCC)cc2OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -18.466
InChIKey:BITJCSKOWIDAEH-UHFFFAOYSA-N
ID: 116969
SMILES:C12C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)CC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 116970
SMILES:CC1(C)C2(C)C3C(C1CC2)Cc1c(O)cc(C(C)C(CC)O)cc1O3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.434
InChIKey:XBVPVUZXJANLTC-UHFFFAOYSA-N