ID: 39838
SMILES:C(c1c(O)c(C2C=C(C)CCC2C(C)C)c(O)c(C2C(C(C)=C)CCC(C)=C2)c1O)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.733
CB1 binding score: -13.82
InChIKey:PKWIPKBKVRFRMN-UHFFFAOYSA-N
ID: 39839
SMILES:Oc1c(CC=C(CCC=C(C)CCC=C(C)C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.604
CB1 binding score: -20.123
InChIKey:WYEFRBILENQYOH-UHFFFAOYSA-N
ID: 39840
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CC(O)C(CO)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.967
InChIKey:XTDYIISRNODHHT-UHFFFAOYSA-N
ID: 39841
SMILES:c1(CCCC)cc(OC2(C)C3C(C)(CCC3O)C(=O)CC(C(C)(C)O)C2)c(O)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.573
CB1 binding score: -18.312
InChIKey:PZSNISRRHKXWOF-UHFFFAOYSA-N
ID: 39842
SMILES:C12(C)CC(O)(Cc3c(cc(CCCCC)cc3O)O1)C(C(C)=C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -13.995
InChIKey:DMIQNPRSISTGTL-UHFFFAOYSA-N
ID: 39843
SMILES:O(C)c1c(O)c2c(cc1CCC)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.226
InChIKey:DUESRGMNOFPQNV-UHFFFAOYSA-N
ID: 39844
SMILES:c1(C)c2c3c(c(O)c1)CC(C(C)=C)C(c1c4ccc(C(C)(C)CCC)c4OC1O3)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.603
CB1 binding score: -13.621
InChIKey:GAQWFZTVIMBZNC-UHFFFAOYSA-N
ID: 39845
SMILES:c1(C(O)C(C)CC)c(O)cc(O)c2c1OC1(C)CC2C(CCC=C(C)C)(C)C2CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -15.549
InChIKey:VYOQKGQKPXJPCD-UHFFFAOYSA-N
ID: 39846
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(C(=O)O)C3OC(C(C)(C)O3)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -16.353
InChIKey:HPLXDPXXFWJMBY-UHFFFAOYSA-N
ID: 39847
SMILES:c1(CCCCC)cc(O)c(CC=C(CCC=C(C)C)C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 300.486
CB1 binding score: -19.003
InChIKey:KXYIDYXHLDYCQN-UHFFFAOYSA-N
ID: 39848
SMILES:C12=C(c3c(cc(CCCCC)cc3O)OC1(C)C)CC(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -18.797
InChIKey:RRDGRYPQJSYRLC-UHFFFAOYSA-N
ID: 39849
SMILES:Oc1c2c(cc(CCCC(=O)C)c1)OC(C)(C)C1CC(=O)C(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -14.605
InChIKey:PJUWDWRLFKKAPN-UHFFFAOYSA-N
ID: 39850
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)ccc12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.189
InChIKey:AIOSXAOKGBOYPS-UHFFFAOYSA-N
ID: 39851
SMILES:C1CC(C)=CC2C1C(C)(C)Oc1cc(O)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -19.859
InChIKey:WRBRAMOWKIFTPD-UHFFFAOYSA-N
ID: 39852
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 39853
SMILES:O(CCCC)C1(C)CCC2C(CO)(C)C3C1c1c(cc(CCCCC)cc1O3)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -16.891
InChIKey:VHTFKQWGVFWJTJ-UHFFFAOYSA-N
ID: 39854
SMILES:C(C=C(C)CCC=C(C)C)c1cc(C(c2c3ccccc3[nH]c2)C)c(O)c(C2C=C(C)CCC2C(C)=C)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 523.761
CB1 binding score: -17.397
InChIKey:DTFVCKJQGXBBOB-UHFFFAOYSA-N
ID: 39855
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(CC=C(C)C1=C)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -16.43
InChIKey:BOWJDMGDLWZXII-UHFFFAOYSA-N
ID: 39856
SMILES:CC(=CC(C(C(C)=CCCC(C)=CCc1c(O)c(C)cc(O)c1)=O)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -14.512
InChIKey:QBULCDNBVDHKRU-UHFFFAOYSA-N
ID: 39857
SMILES:C(=C(C)C)C(c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -16.828
InChIKey:PLJAMKXUAQAILB-UHFFFAOYSA-N
ID: 39858
SMILES:C1(C)=CC(c2c(O)cc(CCCCCO)cc2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.184
InChIKey:ZKGKOAJUWMGRFB-UHFFFAOYSA-N