ID: 133876
SMILES:CC1(C)Oc2cc(CCCCC)cc(OC(=O)C)c2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -17.192
InChIKey:GOVPUJQLCMYBEQ-UHFFFAOYSA-N
ID: 133877
SMILES:c1(OC)c(OC)cc(Br)c2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 367.283
CB1 binding score: -14.371
InChIKey:XCPPKPQUCSHJLC-UHFFFAOYSA-N
ID: 133878
SMILES:C12CCC(C)=CC1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 133879
SMILES:C1=C(C)C(=O)CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.026
InChIKey:FJVJQPVMJALOMF-UHFFFAOYSA-N
ID: 133880
SMILES:C(C(O)=O)c1cc2c(c(O)c1)C1CC(C)(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: Not available
InChIKey:GAUJQWPWWLBHCN-UHFFFAOYSA-N
ID: 133881
SMILES:CC1(C)C2CCC(C)=CC2c2cc(CCCCC)cc(O)c2C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.911
InChIKey:SNQBJQWMDGPAOP-UHFFFAOYSA-N
ID: 133882
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CCCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -19.032
InChIKey:NJSZRBFBYZMAGU-UHFFFAOYSA-N
ID: 133883
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C(=O)C1CC=C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.826
InChIKey:LQENIVOAJRPCCA-UHFFFAOYSA-N
ID: 133884
SMILES:c1(C2C=C(C)CCC2C(=C)C)c(OC)cc(OCC=C(C)C)cc1Br
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 405.376
CB1 binding score: -15.704
InChIKey:CJHKKFMQJXZAQN-UHFFFAOYSA-N
ID: 133885
SMILES:c1(OC)cc(CCC)cc(O)c1C1CCC(O)C=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: Not available
InChIKey:HQKLDSOJWLMEEE-UHFFFAOYSA-N
ID: 133886
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.687
InChIKey:RGXKCMQANRHRCO-UHFFFAOYSA-N
ID: 133887
SMILES:O=C(O)CCCCCc1cc(O)c(CC2C(=C)CCC(O)C2(C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -14.309
InChIKey:JKVICSXVZJYFPK-UHFFFAOYSA-N
ID: 133888
SMILES:C12C=C(C(O)(C)C)CCC(C)(Oc3cc(OC)cc(CCCCC)c3)C1CC=C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -14.485
InChIKey:ZNOQMXNEVQQBDQ-UHFFFAOYSA-N
ID: 133889
SMILES:Oc1c(CC=C(CCC=C(C=O)C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.431
InChIKey:YOPNEMNEITVXDO-UHFFFAOYSA-N
ID: 133890
SMILES:C1C(C)=CC(c2c(O)cc(CCC)cc2O)C(C(C)=C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.378
InChIKey:KUENTZVKZPIPRU-UHFFFAOYSA-N
ID: 133891
SMILES:c1(CCCCCC)cc2c(c(O)c1)C(CCC=C(C)C)(C)C(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.072
InChIKey:VMTVKPXPHXAKDH-UHFFFAOYSA-N
ID: 133892
SMILES:C12CCC(C)=CC1c1c(cc(CCCCC)cc1O)C(=O)C2(CC=C(C)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -15.008
InChIKey:REQQIAOQBFINBF-UHFFFAOYSA-N
ID: 133893
SMILES:c1(CC)cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.786
InChIKey:YURJBXYTSFIOOT-UHFFFAOYSA-N
ID: 133894
SMILES:O(C)c1c(O)c(C=O)c(O)c2c1-c1cc(CCCCC)cc(O)c1C1CC(C)(C)OC(C)(CC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.617
CB1 binding score: -14.313
InChIKey:YTCGWMAUTNOPMH-UHFFFAOYSA-N
ID: 133895
SMILES:OCC1C(O)C(O)C(O)C(OC2CC(C)=CCCC(C)=CC(Oc3cc(CCCCC)cc(O)c3-2)=C)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.647
CB1 binding score: -16.34
InChIKey:SMGWYSXBOCTTQD-UHFFFAOYSA-N
ID: 133896
SMILES:C(C1CCC(C)=CC1c1c(O)cc(CCC)cc1O)(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N