ID: 64849
SMILES:C1CC2(C)Oc3c(c(O)cc(CCCCC)c3)C(CC=C(C)C)C2C(=O)C1C(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -15.118
InChIKey:UCNQOHGJJZSUSP-UHFFFAOYSA-N
ID: 64850
SMILES:C(C(c1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)=C)C)CN
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 315.457
CB1 binding score: -16.466
InChIKey:FLWJSAYHNVZDLS-UHFFFAOYSA-N
ID: 64851
SMILES:C(c1cc(O)cc2c1CC(C(=C)C)CC2)C=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.508
CB1 binding score: -17.527
InChIKey:JOKWXKPHGYKZPX-UHFFFAOYSA-N
ID: 64852
SMILES:C1C2(C)OC3c4c(cc(CCCCC)cc4OC(C)=O)OC31OC(=O)C2C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.433
CB1 binding score: -17.546
InChIKey:FIOBIKKIPSUFIC-UHFFFAOYSA-N
ID: 64853
SMILES:C(CCCCC)(c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.997
InChIKey:LWDBLQTYJUIETF-UHFFFAOYSA-N
ID: 64854
SMILES:C1C2C(CC=C1C=O)C(C)(C)Oc1c2c(O)cc(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -17.451
InChIKey:CRBSYAQNQCKJKP-UHFFFAOYSA-N
ID: 64855
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C)(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.46
CB1 binding score: -18.245
InChIKey:JABOKCHVHQNBRW-UHFFFAOYSA-N
ID: 64856
SMILES:C1C(C)=CC(CC(=CCCC(=CCc2cc(O)cc(C)c2O)C)C)OC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -15.151
InChIKey:OQFCCUGSDVVITR-UHFFFAOYSA-N
ID: 64857
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(C)(C)C1=C2C=C2C(C)(C1)C(C)CCC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -15.929
InChIKey:NUHJUIJXARCHGC-UHFFFAOYSA-N
ID: 64858
SMILES:O1C2(C)CC3C(C(C)(C)Oc4cc(C)c(O)cc43)C1OC2=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.342
CB1 binding score: -12.703
InChIKey:SYIUJZOPQVXZOD-UHFFFAOYSA-N
ID: 64859
SMILES:C(C1C(C)(C)Oc2c(c(O)cc(CCCCC)c2)C1)=CC(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.462
InChIKey:MISUOJPRXQDVEI-UHFFFAOYSA-N
ID: 64860
SMILES:C12(Oc3cc(CCCCC)c(O)c(OC)c31)C(C)CC(=O)C(C(CCC=C(C)C)=C)=C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -13.522
InChIKey:GJZXXAPRSVVSBF-UHFFFAOYSA-N
ID: 64861
SMILES:O1c2c(cc(CCCCC)cc2O)CC(C)(O)C2C1(O)C(=C(C)C)CCC2C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -15.306
InChIKey:GMANJXKHOIHVMW-UHFFFAOYSA-N
ID: 64862
SMILES:CC1(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c2C2C1CC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.507
InChIKey:YKKHSYLGQXKVMO-UHFFFAOYSA-N
ID: 64863
SMILES:C1(C)(C)Oc2c(cc(CCCC)cc2O)C=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 232.323
CB1 binding score: -16.725
InChIKey:NIYDSEBOASGQOT-UHFFFAOYSA-N
ID: 64864
SMILES:C12=C(c3c(cc(CCCCC)cc3O)OC1(C)C)C=C(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -16.502
InChIKey:XESZFUAXECMXLT-UHFFFAOYSA-N
ID: 64865
SMILES:C(CCCc1cc(OC)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 64866
SMILES:c1(CCCCC)cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 64867
SMILES:c1(O)c(CN2Cc3cc(O)c4c(c3C2)OC(C)(C)C2C4C=C(CCC(C(C)=C)OO)CC2)cc(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 507.627
CB1 binding score: -14.91
InChIKey:OAJJUZBOWMIMLV-UHFFFAOYSA-N
ID: 64868
SMILES:C(CCCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -19.71
InChIKey:SFWRRSGOJSILSQ-UHFFFAOYSA-N
ID: 64869
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)=CC1)C(=O)CCOC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -15.871
InChIKey:NTZRLXPEIBSJSE-UHFFFAOYSA-N