ID: 89440
SMILES:C(CC(=O)OCc1cc(O)c2c(c1)C1C(CCC(CO)=C1)C(C)(C)O2)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -13.214
InChIKey:VDZFZBKFTKXCJZ-UHFFFAOYSA-N
ID: 89441
SMILES:C1(c2c(O)cc(CCCCC)cc2)C(C(CCC=C(COC(C=C(C)C)=O)C)C)CC=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.706
CB1 binding score: -13.55
InChIKey:BNDPUHAOTCGAGF-UHFFFAOYSA-N
ID: 89442
SMILES:CC1=CCCC(=C)C2C(CC1)C(C)(C)Oc1c2c(O)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -14.605
InChIKey:UDPQOVUONHIOMH-UHFFFAOYSA-N
ID: 89443
SMILES:C1C23C1(C(=O)c1c(O)cc(CCCCC)cc1O2)C(=O)C(C)(C)O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.38
CB1 binding score: -15.603
InChIKey:QDOYHNOXWKUXMX-UHFFFAOYSA-N
ID: 89444
SMILES:C(Cc1c(O)c2c(c(C(OC)=O)c1)OC(C)(C)C1CCC(C)=CC12)CC(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -15.178
InChIKey:JYVFUIZOGFOFDB-UHFFFAOYSA-N
ID: 89445
SMILES:C1(C(=C)C)(O)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.748
InChIKey:XLWZXLQXWYJJOH-UHFFFAOYSA-N
ID: 89446
SMILES:c1(CCC)ccc(O)c(C2C(C(C)=C)CC(=O)C(C)=C2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -13.713
InChIKey:LFMHYKHCGOHIRY-UHFFFAOYSA-N
ID: 89447
SMILES:C12C(C)CCC1(C(C)=C)c1c(O)c(C(OC)=O)cc(CCCCC)c1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -13.334
InChIKey:IBCUDSGCHGXSLT-UHFFFAOYSA-N
ID: 89448
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N
ID: 89449
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1(O)CCC(O)(C)C=C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.692
InChIKey:ABAIQGZTVAZSBJ-UHFFFAOYSA-N
ID: 89450
SMILES:CC1=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 89451
SMILES:c1(C)c2c(cc(CCCC)c1)OC(C)(C)c1c2cc2c(c1)CCC(=O)C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.54
CB1 binding score: -11.87
InChIKey:WHUWHYPMAXXAQE-UHFFFAOYSA-N
ID: 89452
SMILES:CC12C(C(O)C(C(C)C)CC1)Oc1cc(CCCCC)cc(O)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.638
InChIKey:FRDOVCRHGRNQTF-UHFFFAOYSA-N
ID: 89453
SMILES:CC1=CC2C(C(C)(C)Oc3c2c(C(=O)C(C)C)c(O)c(CC(O)C(=C)C)c3)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -18.94
InChIKey:PSNVRMUAFWSSID-UHFFFAOYSA-N
ID: 89454
SMILES:CC(CCC=C(C)CCC(O)C(OC)(C)C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.645
CB1 binding score: -16.019
InChIKey:UEBHWLKZNOIANV-UHFFFAOYSA-N
ID: 89455
SMILES:C1=C(C)CC2C(C(C)(C)Oc3cc(CCC)c(OC)cc32)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -16.768
InChIKey:VRJGKYPRNVYQJD-UHFFFAOYSA-N
ID: 89456
SMILES:C(C(C)=CCCC1(C)Oc2c(cc(OC)cc2C)C=C1)CC1OC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -18.639
InChIKey:SMSOUEHGPLOQNM-UHFFFAOYSA-N
ID: 89457
SMILES:C1(O)CC(C=C)(C)C(c2c(O)cc(CCCCC)cc2OC)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -15.144
InChIKey:QDKOVQFDEHCVIH-UHFFFAOYSA-N
ID: 89458
SMILES:O1C2C1(C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.322
CB1 binding score: -15.704
InChIKey:QEQDMYKLDOCFRL-UHFFFAOYSA-N
ID: 89459
SMILES:C12C(c3c(cc(CCCC(O)C)cc3O)OC1(C)C)C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.565
InChIKey:SYXCTKNTNBKDQG-UHFFFAOYSA-N
ID: 89460
SMILES:Oc1cc(CCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N